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Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs03463445

You can sort the columns by Ligand, Ligand name, PDB and Tanimoto.


LigandLigand nameChainPDBTanimotoLigand in PDB
LigandLigand nameChainPDBTanimotoLigand in PDB
BPE(2S)-2-AMINO-3-[(3-AMINOPROPYL)SULFANYL]PROPAN-
1-OL
A,B,C1ZPG0.93
CSAS-ACETONYLCYSTEINEA,B1DWQ0.73
ESC2-AMINO-4-ETHYL SULFANYL BUTYRIC ACIDH,P1KBG0.73
SCYS-ACETYL-CYSTEINEA,B,C,D1XPK0.77
SCYS-ACETYL-CYSTEINEA,B,C,D1XPL0.77
SCYS-ACETYL-CYSTEINEA,B2P8U0.77
SCYS-ACETYL-CYSTEINEA2FA30.77
SCYS-ACETYL-CYSTEINEA,B,C,D2F2S0.77
SCYS-ACETYL-CYSTEINEA1MJA0.77
SCYS-ACETYL-CYSTEINEA1HNH0.77
SCYS-ACETYL-CYSTEINEA,B,C,D1XPM0.77
SCYS-ACETYL-CYSTEINEA,B,C,D1DM30.77
SCYS-ACETYL-CYSTEINEA,B,C,D1QFL0.77
SCYS-ACETYL-CYSTEINEA,B,C,D1NL70.77
SCYS-ACETYL-CYSTEINEA2BV50.77
SCYS-ACETYL-CYSTEINEA,B,C,D1M4S0.77
CMES,S-(2-HYDROXYETHYL)THIOCYSTEINEA1HW40.71
CMES,S-(2-HYDROXYETHYL)THIOCYSTEINEA,B,C,D,E,F2C5Q0.71
CMES,S-(2-HYDROXYETHYL)THIOCYSTEINEI,J,K,L,M,N,
O,P
1JZ10.71
CMES,S-(2-HYDROXYETHYL)THIOCYSTEINEA,D2C4O0.71
CMES,S-(2-HYDROXYETHYL)THIOCYSTEINEA2GEV0.71
CMES,S-(2-HYDROXYETHYL)THIOCYSTEINEA,B1HQS0.71
CMES,S-(2-HYDROXYETHYL)THIOCYSTEINEA,B2G5O0.71
CMES,S-(2-HYDROXYETHYL)THIOCYSTEINEA2G4L0.71
CMES,S-(2-HYDROXYETHYL)THIOCYSTEINEA,B,G,H3CFA0.71
CMES,S-(2-HYDROXYETHYL)THIOCYSTEINEA,B,C,D1PZG0.71
CMES,S-(2-HYDROXYETHYL)THIOCYSTEINEA,B2B1V0.71
CMES,S-(2-HYDROXYETHYL)THIOCYSTEINEA,B1Q9U0.71
CMES,S-(2-HYDROXYETHYL)THIOCYSTEINEA1QQQ0.71
CMES,S-(2-HYDROXYETHYL)THIOCYSTEINEA,B1XM40.71
CMES,S-(2-HYDROXYETHYL)THIOCYSTEINEA1WDR0.71
CMES,S-(2-HYDROXYETHYL)THIOCYSTEINEA,B2EF80.71
CMES,S-(2-HYDROXYETHYL)THIOCYSTEINEA,B1XMY0.71
CMES,S-(2-HYDROXYETHYL)THIOCYSTEINEI,J,K,L,M,N,
O,P
1JYZ0.71
CMES,S-(2-HYDROXYETHYL)THIOCYSTEINEA3EWY0.71
CMES,S-(2-HYDROXYETHYL)THIOCYSTEINEA1PME0.71
CMES,S-(2-HYDROXYETHYL)THIOCYSTEINEA,B,C,D1Y8Z0.71
CMES,S-(2-HYDROXYETHYL)THIOCYSTEINEA1YI40.71
CMES,S-(2-HYDROXYETHYL)THIOCYSTEINEA3EWX0.71
CMES,S-(2-HYDROXYETHYL)THIOCYSTEINEA2VB00.71
CMES,S-(2-HYDROXYETHYL)THIOCYSTEINEA,B2FAI0.71
CMES,S-(2-HYDROXYETHYL)THIOCYSTEINEA,B,C,D1QVV0.71
CMES,S-(2-HYDROXYETHYL)THIOCYSTEINEA3FS50.71
CMES,S-(2-HYDROXYETHYL)THIOCYSTEINEA1XOS0.71
CMES,S-(2-HYDROXYETHYL)THIOCYSTEINEA2GES0.71
CMES,S-(2-HYDROXYETHYL)THIOCYSTEINEA,B1XMU0.71
CMES,S-(2-HYDROXYETHYL)THIOCYSTEINEA,B1J3H0.71
CMES,S-(2-HYDROXYETHYL)THIOCYSTEINEA,D2CLW0.71
CMES,S-(2-HYDROXYETHYL)THIOCYSTEINEB,D,F,H,J,L1YKO0.71
CMES,S-(2-HYDROXYETHYL)THIOCYSTEINEA1ELJ0.71
CMES,S-(2-HYDROXYETHYL)THIOCYSTEINEE1R8M0.71
CMES,S-(2-HYDROXYETHYL)THIOCYSTEINEA,B,G,H3CFF0.71
CMES,S-(2-HYDROXYETHYL)THIOCYSTEINEA,B1XOT0.71
CMES,S-(2-HYDROXYETHYL)THIOCYSTEINEA,B1EUD0.71
CMES,S-(2-HYDROXYETHYL)THIOCYSTEINEA1EVF0.71
CMES,S-(2-HYDROXYETHYL)THIOCYSTEINEA2OQX0.71
CMES,S-(2-HYDROXYETHYL)THIOCYSTEINEA,B1Y2J0.71
CMES,S-(2-HYDROXYETHYL)THIOCYSTEINEA3C7Q0.71
CMES,S-(2-HYDROXYETHYL)THIOCYSTEINEA,B1QVW0.71
CMES,S-(2-HYDROXYETHYL)THIOCYSTEINEA,C,D1K2X0.71
CMES,S-(2-HYDROXYETHYL)THIOCYSTEINEA,B1ZKY0.71
CMES,S-(2-HYDROXYETHYL)THIOCYSTEINEA,B2A2J0.71
CMES,S-(2-HYDROXYETHYL)THIOCYSTEINEA1EV80.71
CMES,S-(2-HYDROXYETHYL)THIOCYSTEINEA,B1WZ90.71
CMES,S-(2-HYDROXYETHYL)THIOCYSTEINEA1YHS0.71
CMES,S-(2-HYDROXYETHYL)THIOCYSTEINEA2GA80.71
CMES,S-(2-HYDROXYETHYL)THIOCYSTEINEA2GAA0.71
CMES,S-(2-HYDROXYETHYL)THIOCYSTEINEA,B2P3B0.71
CMES,S-(2-HYDROXYETHYL)THIOCYSTEINEA,B,I1ZPK0.71
CMES,S-(2-HYDROXYETHYL)THIOCYSTEINEA,B2B1Z0.71
CMES,S-(2-HYDROXYETHYL)THIOCYSTEINEA1A1V0.71
CMES,S-(2-HYDROXYETHYL)THIOCYSTEINEA1A2T0.71
CMES,S-(2-HYDROXYETHYL)THIOCYSTEINEA,B1Y2H0.71
CMES,S-(2-HYDROXYETHYL)THIOCYSTEINEA1YPV0.71
CMES,S-(2-HYDROXYETHYL)THIOCYSTEINEA,B,C,D,E,F,
G,H
1JYY0.71
CMES,S-(2-HYDROXYETHYL)THIOCYSTEINEA,B,I1Z8C0.71
CMES,S-(2-HYDROXYETHYL)THIOCYSTEINEA,B2QXS0.71
CMES,S-(2-HYDROXYETHYL)THIOCYSTEINEA,B3ET00.71
CMES,S-(2-HYDROXYETHYL)THIOCYSTEINEA,B2P3A0.71
CMES,S-(2-HYDROXYETHYL)THIOCYSTEINEA,B1KSH0.71
CMES,S-(2-HYDROXYETHYL)THIOCYSTEINEA,B,G,H3CFH0.71
CMES,S-(2-HYDROXYETHYL)THIOCYSTEINEA2V1P0.71
CMES,S-(2-HYDROXYETHYL)THIOCYSTEINEA1OCS0.71
CMES,S-(2-HYDROXYETHYL)THIOCYSTEINEA,B2G440.71
CMES,S-(2-HYDROXYETHYL)THIOCYSTEINEA,B2J830.71
CMES,S-(2-HYDROXYETHYL)THIOCYSTEINEA1EV50.71
CMES,S-(2-HYDROXYETHYL)THIOCYSTEINEA,B1L6Y0.71
CMES,S-(2-HYDROXYETHYL)THIOCYSTEINEA2V0Y0.71
CMES,S-(2-HYDROXYETHYL)THIOCYSTEINEA,B2Q590.71
CMES,S-(2-HYDROXYETHYL)THIOCYSTEINEA1JVY0.71
CMES,S-(2-HYDROXYETHYL)THIOCYSTEINEA,B2P3C0.71
CMES,S-(2-HYDROXYETHYL)THIOCYSTEINEA2AQ50.71
CMES,S-(2-HYDROXYETHYL)THIOCYSTEINEA,E1S9D0.71
CMES,S-(2-HYDROXYETHYL)THIOCYSTEINEA1JEO0.71
CMES,S-(2-HYDROXYETHYL)THIOCYSTEINEA2CZL0.71
CMES,S-(2-HYDROXYETHYL)THIOCYSTEINEA2OCF0.71
CMES,S-(2-HYDROXYETHYL)THIOCYSTEINEA1YI30.71
CMES,S-(2-HYDROXYETHYL)THIOCYSTEINEA,B,C,D,E,F,
Y,Z
2OX50.71
CMES,S-(2-HYDROXYETHYL)THIOCYSTEINEA1EVG0.71
CMES,S-(2-HYDROXYETHYL)THIOCYSTEINEA,B2RD80.71
CMES,S-(2-HYDROXYETHYL)THIOCYSTEINEA,B2B230.71
CMES,S-(2-HYDROXYETHYL)THIOCYSTEINEA,B,C1HQG0.71
CMES,S-(2-HYDROXYETHYL)THIOCYSTEINEA,B2CFA0.71
CMES,S-(2-HYDROXYETHYL)THIOCYSTEINEI,J,K,L,M,N,
O,P
1GHO0.71
CMES,S-(2-HYDROXYETHYL)THIOCYSTEINEA,B1XLX0.71
CMES,S-(2-HYDROXYETHYL)THIOCYSTEINEB,D,F,H,J,L1YKK0.71
CMES,S-(2-HYDROXYETHYL)THIOCYSTEINEA1HW30.71
CMES,S-(2-HYDROXYETHYL)THIOCYSTEINEA,B,C,D1JN90.71
CMES,S-(2-HYDROXYETHYL)THIOCYSTEINEA,B,D,F,H,J,L1YKP0.71
CMES,S-(2-HYDROXYETHYL)THIOCYSTEINEA,B1XLZ0.71
CMES,S-(2-HYDROXYETHYL)THIOCYSTEINEA1TAZ0.71
CMES,S-(2-HYDROXYETHYL)THIOCYSTEINEA2GET0.71
CMES,S-(2-HYDROXYETHYL)THIOCYSTEINEA,B2QA80.71
CMES,S-(2-HYDROXYETHYL)THIOCYSTEINEA,B2QZO0.71
CMES,S-(2-HYDROXYETHYL)THIOCYSTEINEA1XV50.71
CMES,S-(2-HYDROXYETHYL)THIOCYSTEINEA,B,C,D,E,F,
G,H
1JZ00.71
CMES,S-(2-HYDROXYETHYL)THIOCYSTEINEA,B1XN00.71
CMES,S-(2-HYDROXYETHYL)THIOCYSTEINEA1UPI0.71
CMES,S-(2-HYDROXYETHYL)THIOCYSTEINEB,D,F,H,J,L1YKM0.71
CMES,S-(2-HYDROXYETHYL)THIOCYSTEINEA,B1XM60.71
CMES,S-(2-HYDROXYETHYL)THIOCYSTEINEB,D,F,H,J,L1YKN0.71
CMES,S-(2-HYDROXYETHYL)THIOCYSTEINEA2ONB0.71
CMES,S-(2-HYDROXYETHYL)THIOCYSTEINEA1TLV0.71
CMES,S-(2-HYDROXYETHYL)THIOCYSTEINEA,B,C,D1HVY0.71
CMES,S-(2-HYDROXYETHYL)THIOCYSTEINEA,B3D6I0.71
CMES,S-(2-HYDROXYETHYL)THIOCYSTEINEA,B1OCU0.71
CMES,S-(2-HYDROXYETHYL)THIOCYSTEINEA,B,I1ZBG0.71
CMES,S-(2-HYDROXYETHYL)THIOCYSTEINEA2GEU0.71
CMES,S-(2-HYDROXYETHYL)THIOCYSTEINEA2HAI0.71
CMES,S-(2-HYDROXYETHYL)THIOCYSTEINEA,B1EUC0.71
CMES,S-(2-HYDROXYETHYL)THIOCYSTEINEA,B,C,D,E,F,
G,H
1F490.71
CMES,S-(2-HYDROXYETHYL)THIOCYSTEINEA,B1L6S0.71
CMES,S-(2-HYDROXYETHYL)THIOCYSTEINEA,B1KSJ0.71
MEDD-METHIONINEA1Y9Q0.71
MEDD-METHIONINEA,B2Q330.71
MEDD-METHIONINEA1ZUE0.71
MEDD-METHIONINEA1KQ00.71
MEDD-METHIONINEA,B3GP40.71
MEDD-METHIONINEA1TKJ0.71
YCMS-(2-AMINO-2-OXOETHYL)-L-CYSTEINEA,B,C,D1L0Q0.7
YCMS-(2-AMINO-2-OXOETHYL)-L-CYSTEINEA,B,I3DCR0.7
YCMS-(2-AMINO-2-OXOETHYL)-L-CYSTEINEA,B2A8Q0.7
YCMS-(2-AMINO-2-OXOETHYL)-L-CYSTEINEA,B3FL10.7
YCMS-(2-AMINO-2-OXOETHYL)-L-CYSTEINEA,I2O400.7
YCMS-(2-AMINO-2-OXOETHYL)-L-CYSTEINEL2R0Z0.7
YCMS-(2-AMINO-2-OXOETHYL)-L-CYSTEINEA,B1TQ90.7
YCMS-(2-AMINO-2-OXOETHYL)-L-CYSTEINEL2R0W0.7
YCMS-(2-AMINO-2-OXOETHYL)-L-CYSTEINEA,B1PX50.7
YCMS-(2-AMINO-2-OXOETHYL)-L-CYSTEINEH,L1TJG0.7
YCMS-(2-AMINO-2-OXOETHYL)-L-CYSTEINEH,L3EYU0.7
YCMS-(2-AMINO-2-OXOETHYL)-L-CYSTEINEA1N3Z0.7
YCMS-(2-AMINO-2-OXOETHYL)-L-CYSTEINEA,B2A8S0.7
YCMS-(2-AMINO-2-OXOETHYL)-L-CYSTEINEH,L,Q3EYS0.7
YCMS-(2-AMINO-2-OXOETHYL)-L-CYSTEINEA3ESW0.7
YCMS-(2-AMINO-2-OXOETHYL)-L-CYSTEINEA,B,C,D3BCP0.7
YCMS-(2-AMINO-2-OXOETHYL)-L-CYSTEINEA,B3FKZ0.7
YCMS-(2-AMINO-2-OXOETHYL)-L-CYSTEINEA,B3FL30.7
YCMS-(2-AMINO-2-OXOETHYL)-L-CYSTEINEH,L,P1TJI0.7
YCMS-(2-AMINO-2-OXOETHYL)-L-CYSTEINEA,B2A8P0.7
YCMS-(2-AMINO-2-OXOETHYL)-L-CYSTEINEA,B2A8R0.7
YCMS-(2-AMINO-2-OXOETHYL)-L-CYSTEINEA,B3FL00.7
YCMS-(2-AMINO-2-OXOETHYL)-L-CYSTEINEA1N1X0.7
YCMS-(2-AMINO-2-OXOETHYL)-L-CYSTEINEH,L,P1TJH0.7
YCMS-(2-AMINO-2-OXOETHYL)-L-CYSTEINEA,B,I3DCK0.7
BBC3-[(4-AMINOBUTYL)SULFINYL]-2-IMINOPROPAN-
1-OL
A,B,C1ZPE0.71
M0HS-(HYDROXYMETHYL)-L-CYSTEINEA2PFG0.77
S2CS-2-(BORONOETHYL)-L-CYSTEINEA,B1HQ50.73
S2CS-2-(BORONOETHYL)-L-CYSTEINEA,B,C3E9B0.73
S2CS-2-(BORONOETHYL)-L-CYSTEINEA,B1P8R0.73
S2CS-2-(BORONOETHYL)-L-CYSTEINEA,B1WVA0.73
S2CS-2-(BORONOETHYL)-L-CYSTEINEA,B,C,D,E,F1PQ30.73
S2CS-2-(BORONOETHYL)-L-CYSTEINEA,B1WVB0.73
SHCS-HEXYLCYSTEINEI,J1GSS0.71
SMCS-METHYLCYSTEINEA,B,C,E,F,H,
I,J,K,M,O,P,
R,T,V,W
1UZD0.74
SMCS-METHYLCYSTEINEA,B,C,D,E,F,
G,H,I,J,K,L,
M,N,O,P
2VDI0.74
SMCS-METHYLCYSTEINEA1U8B0.74
SMCS-METHYLCYSTEINEA,B,C,D,E,F,
G,H,I,J,K,L,
M,N,O,P
2VDH0.74
SMCS-METHYLCYSTEINEA1FQ40.74
SMCS-METHYLCYSTEINEA,B,C,D,E,F1HBO0.74
SMCS-METHYLCYSTEINEA,B,C,D,E,F,
G,H,I,J,K,L,
M,N,O,P
2V630.74
SMCS-METHYLCYSTEINEI1E820.74
SMCS-METHYLCYSTEINEI1E810.74
SMCS-METHYLCYSTEINEA,B,C,E,H,I,
J,K,M,O,P,R,
T,V,W
1UW90.74
SMCS-METHYLCYSTEINEA1LFO0.74
SMCS-METHYLCYSTEINEA,B,D,E,H,K,
O,R,V
1UWA0.74
SMCS-METHYLCYSTEINEA,C,D,F1MRO0.74
SMCS-METHYLCYSTEINE1,2,3,4,5,6,
7,8,A,B,C,D,
E,F,G,H,I,J,
K,L,M,N,O,P,
S,T,U,V,W,X,
Y,Z
1IR20.74
SMCS-METHYLCYSTEINEA1ZGW0.74
SMCS-METHYLCYSTEINEE,I1EPN0.74
SMCS-METHYLCYSTEINEA,B,C2OB20.74
SMCS-METHYLCYSTEINEA,B,C,D,E,F,
G,H,I,J,K,L,
M,N,O,P
2V670.74
SMCS-METHYLCYSTEINEP1CZI0.74
SMCS-METHYLCYSTEINEA,C,D,F1E6Y0.74
SMCS-METHYLCYSTEINEA,I1GVT0.74
SMCS-METHYLCYSTEINEA,B,C,D,E,F1HBM0.74
SMCS-METHYLCYSTEINEA,B,C,D,E,F,
G,H,I,J,K,L,
M,N,O,P
2V680.74
SMCS-METHYLCYSTEINEA,B,C,E,F,H,
J,K,M,O,P,R,
T,V,W
1UZH0.74
SMCS-METHYLCYSTEINEA1EH70.74
SMCS-METHYLCYSTEINEA,C,E,G,I,K,
M,O
1GK80.74
SMCS-METHYLCYSTEINEA,B,C,D,E,F,
G,H,I,J,K,L,
M,N,O,P
2V6A0.74
SMCS-METHYLCYSTEINEA,B,C,D,E,F,
G,H,I,J,K,L,
M,N,O,P
2V690.74
SMCS-METHYLCYSTEINEA1WPK0.74
SMCS-METHYLCYSTEINEA,B,C,D,E,F1HBN0.74
SMCS-METHYLCYSTEINEA,B,C,D,E,F1HBU0.74
CS0S-(2-HYDROXYETHYL)-L-CYSTEINEA1ASV0.81
SLZL-THIALYSINEA,B,D,E,F2O6V0.73
SLZL-THIALYSINEA,B,D2J9K0.73
SLZL-THIALYSINEL1BM20.73
SLZL-THIALYSINEX3DIG0.73
SLZL-THIALYSINEA,B,C2J9J0.73
CY4S-BUTYRYL-CYSTEINA,B,C,D1M4T0.75
MT2[(3S)-3-amino-3-carboxypropyl](ethyl)methylsulfoniumA3C8F0.72
CCSCARBOXYMETHYLATED CYSTEINEE1STF0.73
CCSCARBOXYMETHYLATED CYSTEINEA,B,C,D,E,F1GTI0.73
CCSCARBOXYMETHYLATED CYSTEINEA,B2BJ40.73
CCSCARBOXYMETHYLATED CYSTEINEA,B2JFA0.73
CCSCARBOXYMETHYLATED CYSTEINEG,R1DSS0.73
CCSCARBOXYMETHYLATED CYSTEINEA,B1L2I0.73
CCSCARBOXYMETHYLATED CYSTEINEA,B,C,D3DMT0.73
CCSCARBOXYMETHYLATED CYSTEINEA,B1ERR0.73
CCSCARBOXYMETHYLATED CYSTEINEA2JX40.73
HTI(4S)-4-{[(2S)-2-AMINO-3-OXOPROPYL]SULFANYL}-
L-HOMOSERINE
C2R000.7
HTI(4S)-4-{[(2S)-2-AMINO-3-OXOPROPYL]SULFANYL}-
L-HOMOSERINE
A,B1NWH0.7
HTI(4S)-4-{[(2S)-2-AMINO-3-OXOPROPYL]SULFANYL}-
L-HOMOSERINE
A1NX60.7
HTI(4S)-4-{[(2S)-2-AMINO-3-OXOPROPYL]SULFANYL}-
L-HOMOSERINE
A1PU20.7
HTI(4S)-4-{[(2S)-2-AMINO-3-OXOPROPYL]SULFANYL}-
L-HOMOSERINE
A,B1Q2X0.7
OCYHYDROXYETHYLCYSTEINEA1VSH0.81
OCYHYDROXYETHYLCYSTEINEA3FV80.81
OCYHYDROXYETHYLCYSTEINEA3FI30.81
OCYHYDROXYETHYLCYSTEINEA,B2R9S0.81
OCYHYDROXYETHYLCYSTEINEA1VSI0.81
OCYHYDROXYETHYLCYSTEINEA1VSJ0.81
OCYHYDROXYETHYLCYSTEINEA1VSD0.81
OCYHYDROXYETHYLCYSTEINEA3FI20.81